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Chemical structure of 666-15

GC32689

666-15

Also known as 3-(3-aminopropoxy)-N-[2-[3-[(4-chloro-2-hydroxyphenyl)carbamoyl]naphthalen-2-yl]oxyethyl]naphthalene-2-carboxamide;hydrochloride

666-15 is a selective cyclic AMP response element binding protein (CREB) inhibitor with an IC50 value of 0·081±0·04μM

ChemicalCAS1433286-70-4MW620.52FormulaC33H31Cl2N3O5
CAS number
1433286-70-4
Molecular weight
620.52
Formula
C33H31Cl2N3O5
Solubility
DMSO ： ≥ 30 mg/mL (48·35 mM)
InChIKey
LELLCPHHYHLWBH-UHFFFAOYSA-N
Catalogue number
GC32689
Brand
GLPBIO
Computed properties PubChem CID 71566396 · TPSA 123 Ų · H-bond donors 5 · H-bond acceptors 6
TPSA
123 Ų
H-bond donors
5
H-bond acceptors
6
Rotatable bonds
11
Heavy atoms
43

SMILES C1=CC=C2C=C(C(=CC2=C1)C(=O)NCCOC3=CC4=CC=CC=C4C=C3C(=O)NC5=C(C=C(C=C5)Cl)O)OCCCN.Cl

Computed descriptors from PubChem (CID 71566396), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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